8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene

C24H33F — CID 139960471

IUPAC8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene
SMILESCC=CCCC1CCC(c2ccc3c(c2F)CCC(CCC)=C3)CC1
InChIInChI=1S/C24H33F/c1-3-5-6-8-18-9-12-20(13-10-18)22-16-14-21-17-19(7-4-2)11-15-23(21)24(22)25/h3,5,14,16-18,20H,4,6-13,15H2,1-2H3
InChIKeyJHYBKRWKNAEHIS-UHFFFAOYSA-N
MW340.53 g/mol
LogP7.59
Rot. Bonds6

About 8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene

8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene (PubChem CID 139960471) has the molecular formula C24H33F and a molecular weight of 340.53 g/mol. Its IUPAC name is 8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene.

Molecular Properties

Compound Name8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene
PubChem CID139960471
Molecular FormulaC24H33F
Molecular Weight340.53 g/mol
Exact Mass340.26
IUPAC Name8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene
SMILESCC=CCCC1CCC(c2ccc3c(c2F)CCC(CCC)=C3)CC1
InChIInChI=1S/C24H33F/c1-3-5-6-8-18-9-12-20(13-10-18)22-16-14-21-17-19(7-4-2)11-15-23(21)24(22)25/h3,5,14,16-18,20H,4,6-13,15H2,1-2H3
InChIKeyJHYBKRWKNAEHIS-UHFFFAOYSA-N
XLogP7.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.53
LogP ≤ 57.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-ethoxy-2,3-difluoro-4-[4-[(E)-pent-3-enyl]cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-(4-pentylcyclohexyl)benzene
CID 160550252
1-[4-[2,3-difluoro-4-[4-(4-pent-3-enylcyclohexyl)cyclohexyl]phenyl]phenyl]-2,3-difluoro-4-propylbenzene
CID 77345546
1-[4-(2,3-difluoro-4-methylphenyl)phenyl]-2,3-difluoro-4-[4-[(E)-pent-3-enyl]cyclohexyl]benzene
CID 67730829
6-fluoro-7-(4-pentylcyclohexyl)-3-propyl-1,2-dihydronaphthalene
CID 139961393
3-[2-(4-butylcyclohexyl)ethyl]-7-(2,3-difluorophenyl)-8-fluoro-1,2-dihydronaphthalene
CID 139960499
1-[4-[2,3-difluoro-4-[4-[(E)-pent-3-enyl]cyclohexyl]phenyl]phenyl]-4-ethoxy-2,3-difluorobenzene
CID 67730875
1-[4-(2,3-difluoro-4-hexylphenyl)phenyl]-2,3-difluoro-4-[4-(4-pent-3-enylcyclohexyl)cyclohexyl]benzene
CID 77345564
7-(2,3-difluorophenyl)-8-fluoro-3-[2-(4-hexylcyclohexyl)ethyl]-1,2-dihydronaphthalene
CID 139960552
1-[4-[2,3-difluoro-4-(4-pent-3-enylcyclohexyl)phenyl]phenyl]-2,3-difluoro-4-pentoxybenzene
CID 77343618
2-[3-chloro-2-fluoro-4-[4-[4-[4-[(E)-pent-3-enyl]cyclohexyl]cyclohexyl]cyclohexyl]phenyl]oxirane
CID 89046705
2,3-difluoro-1-propyl-4-(4-propylcyclohexyl)benzene
CID 19103623
1-[2,3-difluoro-4-[4-[4-[(E)-pent-3-enyl]cyclohexyl]cyclohexyl]phenyl]-2,3-difluoro-4-[(E)-prop-1-enoxy]benzene
CID 90161638

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene?
The IUPAC name of 8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene (CID 139960471) is 8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene.
What is the SMILES notation for 8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene?
The canonical SMILES for 8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene is CC=CCCC1CCC(c2ccc3c(c2F)CCC(CCC)=C3)CC1.
What is the InChIKey of 8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene?
The InChIKey is JHYBKRWKNAEHIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33F/c1-3-5-6-8-18-9-12-20(13-10-18)22-16-14-21-17-19(7-4-2)11-15-23(21)24(22)25/h3,5,14,16-18,20H,4,6-13,15H2,1-2H3.
What are the key properties of 8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene?
8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene has a molecular weight of 340.53 g/mol, XLogP of 7.59, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-7-(4-pent-3-enylcyclohexyl)-3-propyl-1,2-dihydronaphthalene is sourced from PubChem (CID 139960471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).